A0A087X5I0_POEFO Loading...

Large ribosomal subunit protein bL35m

AlphaFold DB (A0A3B3U5N8), UniProt , Accession A0A087X5I0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 174 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.6Very low47Very low249 Ų249145 Ų145100%1.22784%0.843SS**  089.50-70.2-70.4-162.900108.2
2A39.8Very low47.3Very low107 Ų107146.5 Ų146.588%0.88484%0.844SS**  trans-92.4138.6178.700000109.5
3A46.7Very low47.3Very low97 Ų97146.9 Ų146.980%0.80284%0.84SS**  trans-143.5101.5162.700000108.7
4A46.9Very low47.5Very low96 Ų96153.3 Ų153.379%0.79384%0.844SS**  trans-71.3137.2169.800000109.5
5V51.4Low47.6Very low147 Ų147151 Ų15189%0.89184%0.839SS**  trans-122.9133167.4178.50000109.8
6V47.4Very low47.6Very low113 Ų113152.6 Ų152.669%0.68584%0.844SS**  trans-90.2138.1-151166.90000111.8R8V6-R8 HydrophobicContact CG1-CG 4.34Å
7R48.7Very low47.4Very low222 Ų222154 Ų15484%0.83884%0.835SS**  trans-68122.5167.5-161.3174.6155.4167-6.5109.3
8R44.7Very low47.1Very low229 Ų229157.8 Ų157.886%0.86484%0.836SS**  trans-131.6110.9163.3-82.3-169.3-177.8-1321.2111.2V6V6-R8 HydrophobicContact CG1-CG 4.34Å
9L50.7Low46.9Very low154 Ų154158.6 Ų158.681%0.80683%0.831SS**  trans-79.8134.4158.3-68.6166.1000107.6
10S49.7Very low46.8Very low115 Ų115156.4 Ų156.480%0.80483%0.825SS**  trans-143.4100.2164.943.70000108.8
11G46.3Very low46.6Very low66 Ų66151.8 Ų151.868%0.6881%0.814SS**  trans-81.4-171.8155.300000111.1
12L50.7Low46.4Very low163 Ų163146.2 Ų146.285%0.85380%0.795SS**  trans83.2119176.2-60174.8000112.9
13L47.5Very low46.8Very low152 Ų152146.5 Ų146.580%0.79679%0.79SS**  cis-167.2162.421.9-87.2146.2000110.3
14R49.3Very low46.9Very low236 Ų236146.8 Ų146.889%0.89179%0.786SS**  trans111.9146.7153.6-68.6-175.7167.7-171.6-2.2116.9
15P50.3Low46.9Very low119 Ų119147.7 Ų147.777%0.77378%0.784SS**  cis-125.5153-49.329.5-12.4000111.2Y17P15-Y17 PolarHBondContact O-N 2.76Å
16L46.5Very low46.7Very low176 Ų176149.3 Ų149.392%0.92178%0.782SS**  trans-64.9113.3173.9-66.9167.7000110.2R18L16-R18 PolarHBondContact O-N 3.11Å
17Y44.7Very low46.7Very low177 Ų177150.9 Ų150.969%0.69479%0.785SS**  trans-74.1107.2166-169.9-80.4000108.8P15 F19P15-Y17 PolarHBondContact O-N 2.76Å; Y17-F19 HydrophobicContact CD1-CB 4.44Å; Y17-F19 AromaticContact CD1-CD2 3.2Å; Y17-F19 HydrophobicContact CD1-CD2 3.2Å; Y17-F19 AromaticContact CD1-CE2 3.34Å; Y17-F19 HydrophobicContact CD1-CE2 3.34Å; Y17-F19 AromaticContact CD1-CG 3.83Å; Y17-F19 HydrophobicContact CD1-CG 3.83Å; Y17-F19 HydrophobicContact CD1-CZ 4.07Å; Y17-F19 HydrophobicContact CE1-CB 4.26Å; Y17-F19 AromaticContact CE1-CD1 3.65Å; Y17-F19 HydrophobicContact CE1-CD1 3.65Å; Y17-F19 AromaticContact CE1-CD2 3.11Å; Y17-F19 HydrophobicContact CE1-CD2 3.11Å; Y17-F19 AromaticContact CE1-CE1 3.59Å; Y17-F19 HydrophobicContact CE1-CE1 3.59Å; Y17-F19 AromaticContact CE1-CE2 3.03Å; Y17-F19 HydrophobicContact CE1-CE2 3.03Å; Y17-F19 AromaticContact CE1-CG 3.41Å; Y17-F19 HydrophobicContact CE1-CG 3.41Å; Y17-F19 VanDerWaalsContact CE1-CG 3.41Å; Y17-F19 AromaticContact CE1-CZ 3.28Å; Y17-F19 HydrophobicContact CE1-CZ 3.28Å; Y17-F19 HydrophobicContact CG-CD2 4.49Å; Y17-F19 HydrophobicContact CG-CE2 4.44Å; Y17-F19 AromaticContact CZ-CE2 3.91Å; Y17-F19 AromaticContact CZ-CZ 3.77Å; Y17-F19 PolarHBondContact O-N 2.87Å
18R41.3Very low46.7Very low223 Ų223151.6 Ų151.684%0.84279%0.788SS**  trans-82.196.5174.6-158.6176.5-158.4165.64108.2L16 V20L16-R18 PolarHBondContact O-N 3.11Å; R18-V20 HydrophobicContact CG-CG2 4.29Å; R18-V20 PolarHBondContact O-N 2.81Å; R18-V20 VanDerWaalsContact O-N 3.11Å
19F43.5Very low46.8Very low172 Ų172149.3 Ų149.375%0.75479%0.787SS**  trans-7397.4164.6-95.4-73.3000108.4Y17Y17-F19 HydrophobicContact CD1-CB 4.44Å; Y17-F19 AromaticContact CD1-CD2 3.2Å; Y17-F19 HydrophobicContact CD1-CD2 3.2Å; Y17-F19 AromaticContact CD1-CE2 3.34Å; Y17-F19 HydrophobicContact CD1-CE2 3.34Å; Y17-F19 AromaticContact CD1-CG 3.83Å; Y17-F19 HydrophobicContact CD1-CG 3.83Å; Y17-F19 HydrophobicContact CD1-CZ 4.07Å; Y17-F19 HydrophobicContact CE1-CB 4.26Å; Y17-F19 AromaticContact CE1-CD1 3.65Å; Y17-F19 HydrophobicContact CE1-CD1 3.65Å; Y17-F19 AromaticContact CE1-CD2 3.11Å; Y17-F19 HydrophobicContact CE1-CD2 3.11Å; Y17-F19 AromaticContact CE1-CE1 3.59Å; Y17-F19 HydrophobicContact CE1-CE1 3.59Å; Y17-F19 AromaticContact CE1-CE2 3.03Å; Y17-F19 HydrophobicContact CE1-CE2 3.03Å; Y17-F19 AromaticContact CE1-CG 3.41Å; Y17-F19 HydrophobicContact CE1-CG 3.41Å; Y17-F19 VanDerWaalsContact CE1-CG 3.41Å; Y17-F19 AromaticContact CE1-CZ 3.28Å; Y17-F19 HydrophobicContact CE1-CZ 3.28Å; Y17-F19 HydrophobicContact CG-CD2 4.49Å; Y17-F19 HydrophobicContact CG-CE2 4.44Å; Y17-F19 AromaticContact CZ-CE2 3.91Å; Y17-F19 AromaticContact CZ-CZ 3.77Å; Y17-F19 PolarHBondContact O-N 2.87Å
20V44.8Very low46.4Very low115 Ų115150.2 Ų150.270%0.69779%0.791SS**  trans-80.1119.2161.1173.90000107R18R18-V20 HydrophobicContact CG-CG2 4.29Å; R18-V20 PolarHBondContact O-N 2.81Å; R18-V20 VanDerWaalsContact O-N 3.11Å
21G43.4Very low46Very low59 Ų59149.5 Ų149.561%0.60879%0.787SS**  trans-80157.6167.100000111.7
22T40.4Very low45.9Very low132 Ų132149.6 Ų149.681%0.8179%0.787SS**  trans149.2137.2160.546.40000105.2
23S46.9Very low45.7Very low113 Ų113151.4 Ų151.479%0.7979%0.789SS**  cis-162.6168.5-0-83.50000107.5
24S50.6Low45.5Very low103 Ų103151.9 Ų151.972%0.7279%0.79SS**  trans-35.3149.1179.7-176.40000118.1Q26S24-Q26 PolarHBondContact O-N 2.92Å
25P45.7Very low45.4Very low115 Ų115150.9 Ų150.975%0.74779%0.786SS**PPolyproline II helixtrans-64.9133.116728.9-33.8000111.3I27P25-I27 PolarHBondContact O-N 3.2Å
26Q47.7Very low45.1Very low182 Ų182149.4 Ų149.485%0.8579%0.785SS**PPolyproline II helixtrans-59.7122.3173.2-82.6-80.7-11.500111.2S24 R28S24-Q26 PolarHBondContact O-N 2.92Å; Q26-R28 PolarHBondContact O-N 2.97Å
27I48.3Very low45.5Very low145 Ų145147.5 Ų147.574%0.74477%0.771SS**PPolyproline II helixtrans-74.9116.2165.9-68.5171.4000106.7P25 Q29P25-I27 PolarHBondContact O-N 3.2Å; I27-Q29 PolarHBondContact O-N 3.15Å; I27-Q29 VanDerWaalsContact O-N 3.09Å
28R46.9Very low45.7Very low237 Ų237144.8 Ų144.889%0.89478%0.775SS**  trans-60.1109.6169.4-73.8-174.1171.1-156.5-2.7108.9Q26 L30Q26-R28 PolarHBondContact O-N 2.97Å; R28-L30 PolarHBondContact O-N 3.43Å
29Q47.2Very low46Very low182 Ų182141.7 Ų141.785%0.8577%0.774SS**  trans-75.9117164.6-65-157.64.700108.3I27 S31I27-Q29 PolarHBondContact O-N 3.15Å; I27-Q29 VanDerWaalsContact O-N 3.09Å; Q29-S31 PolarHBondContact O-N 2.8Å
30L43Very low46.2Very low172 Ų172143.6 Ų143.690%0.90178%0.783SS**  trans-71108.8167.1-76.6162.3000107.4R28 G32R28-L30 PolarHBondContact O-N 3.43Å; L30-G32 PolarHBondContact O-N 2.85Å
31S41.4Very low46.1Very low101 Ų101141.8 Ų141.871%0.70679%0.787SS**  trans-64.597.416852.50000109.2Q29 F33Q29-S31 PolarHBondContact O-N 2.8Å; S31-F33 PolarHBondContact O-N 2.98Å
32G44.9Very low46.5Very low67 Ų67145.7 Ų145.769%0.69180%0.799SS**  trans-69.3112.9162.400000108.6L30 I34L30-G32 PolarHBondContact O-N 2.85Å; G32-I34 PolarHBondContact O-N 3.17Å
33F46.2Very low46.8Very low202 Ų202144.1 Ų144.189%0.88680%0.8SS**  trans-62.396.4171.1-82.6-93.7000109.6S31 R35S31-F33 PolarHBondContact O-N 2.98Å; F33-R35 PolarHBondContact O-N 2.94Å
34I43.5Very low46.9Very low161 Ų161145.5 Ų145.583%0.82680%0.803SS**  trans-80.6102.2159.1-61-178000106.2G32 A36G32-I34 PolarHBondContact O-N 3.17Å; I34-A36 PolarHBondContact O-N 2.8Å
35R46.3Very low46.6Very low215 Ų215145.3 Ų145.381%0.81181%0.808SS**  trans-65.297170.9-175.4-178.2-172.9-175.51.8108.6F33F33-R35 PolarHBondContact O-N 2.94Å
36A43.6Very low47Very low89 Ų89144.3 Ų144.374%0.73681%0.81SS**  trans-92.9115.8165.200000108.5I34I34-A36 PolarHBondContact O-N 2.8Å
37Q55Low46.9Very low136 Ų136142.4 Ų142.464%0.63681%0.81SS**  trans-77.6140.2167.3-62.7-160.1-9.100109.4
38P50.1Low46.9Very low120 Ų120141.5 Ų141.578%0.77982%0.816SS**  trans-90.6111.9154.99.19.2000108.9
39L46.8Very low47.2Very low158 Ų158134.1 Ų134.183%0.82781%0.805SS**  trans-75.9128.8161.3-79.8158.2000108.4
40F46.7Very low47.3Very low212 Ų212131.3 Ų131.393%0.9380%0.802SS**  trans-65.7135.8159.8-68-88.5000108.7
41G44.3Very low48Very low76 Ų76129.6 Ų129.678%0.78480%0.799SS**  trans-179.9104.3176.200000112.6
42T50.4Low48.3Very low142 Ų142135.7 Ų135.787%0.87181%0.806SS**  trans-55.1146.9177.134.50000114.4
43A48.3Very low48.7Very low99 Ų99136.7 Ų136.782%0.81881%0.808SS**  trans-58.9136.4178.500000113.6
44T47.7Very low49Very low141 Ų141133 Ų13387%0.86580%0.802SS**  trans-141.6133.3153.148.90000111.3
45A44.9Very low49.4Very low99 Ų99131.3 Ų131.382%0.81880%0.799SS**  trans24.6124.8158.300000121.4
46A53.4Low49.7Very low95 Ų95125 Ų12579%0.78579%0.793SS**  trans-61.6136.7168.900000113.3
47V46.2Very low50.3Low141 Ų141128 Ų12886%0.85580%0.796SS**  trans-127.8109.8157.7178.30000107.1A49V47-A49 PolarHBondContact O-N 3.08Å; V47-A49 VanDerWaalsContact O-N 3.15Å
48C48.9Very low50.3Low127 Ų127126.6 Ų126.686%0.85880%0.797SS**  trans-69.5104.2176.5-68.20000109.9
49A53.3Low50.7Low81 Ų81124.6 Ų124.667%0.66978%0.783SS**  trans-84.1136.1163.700000109.3V47 V51V47-A49 PolarHBondContact O-N 3.08Å; V47-A49 VanDerWaalsContact O-N 3.15Å; A49-V51 PolarHBondContact O-N 3.22Å
50P49.2Very low51.4Low123 Ų123128.6 Ų128.680%0.79979%0.787SS**  trans-64.8122.9179.625.6-32.4000110R52P50-R52 PolarHBondContact O-N 3.33Å
51V56.2Low52.1Low136 Ų136124.8 Ų124.882%0.82477%0.768SS**  trans-59.4105.2173.11780000107.7A49 A53A49-V51 PolarHBondContact O-N 3.22Å; V51-A53 VanDerWaalsContact C-N 3.33Å; V51-A53 PolarHBondContact O-N 3.15Å
52R49.2Very low53.6Low230 Ų230125 Ų12587%0.86876%0.755SS**  trans-64.599.9165.2-76-175.1174.9168.9-0.7107P50 T54P50-R52 PolarHBondContact O-N 3.33Å; R52-T54 PolarHBondContact O-N 3.32Å
53A52.7Low54.5Low88 Ų88124.6 Ų124.673%0.72775%0.747SS**  trans-62.989167.300000107.9V51 V55V51-A53 VanDerWaalsContact C-N 3.33Å; V51-A53 PolarHBondContact O-N 3.15Å; A53-V55 PolarHBondContact O-N 3.27Å; A53-V55 VanDerWaalsContact O-N 3.11Å
54T52.6Low55.2Low123 Ų123125.9 Ų125.976%0.75574%0.74SS**  trans-65.1111.5162.343.20000105.5R52 A56R52-T54 PolarHBondContact O-N 3.32Å; T54-A56 PolarHBondContact O-N 2.98Å
55V51.3Low56.3Low126 Ų126125.1 Ų125.176%0.76473%0.727SS**  trans-61.891.5167.9179.60000105.6A53 L57A53-V55 PolarHBondContact O-N 3.27Å; A53-V55 VanDerWaalsContact O-N 3.11Å; V55-L57 VanDerWaalsContact C-N 3.3Å; V55-L57 PolarHBondContact O-N 2.82Å
56A53.1Low57.6Low82 Ų82128.1 Ų128.168%0.67872%0.717SS**  trans-65.897175.500000106.5T54 T58T54-A56 PolarHBondContact O-N 2.98Å; A56-T58 VanDerWaalsContact C-N 3.34Å; A56-T58 PolarHBondContact O-N 3.04Å
57L55.4Low58.5Low154 Ų154126.6 Ų126.681%0.80670%0.697SS**  trans-57.1103.5169.6-69.2170.7000106.4V55V55-L57 VanDerWaalsContact C-N 3.3Å; V55-L57 PolarHBondContact O-N 2.82Å
58T55.9Low59.8Low106 Ų106121.4 Ų121.465%0.6567%0.667SS**  trans-53.1128.6177.457.40000107.4A56 R60A56-T58 VanDerWaalsContact C-N 3.34Å; A56-T58 PolarHBondContact O-N 3.04Å; T58-R60 PolarHBondContact O-N 3.08Å
59P58.3Low60.7Low77 Ų77119.5 Ų119.550%0.566%0.661SS.*  trans-54.7118.9176.9-21.230.6000107.7Y61P59-Y61 HydrophobicContact CB-CD1 4.45Å; P59-Y61 HydrophobicContact CB-CE1 3.85Å; P59-Y61 HydrophobicContact CB-CE2 3.98Å; P59-Y61 HydrophobicContact CG-CE2 4.38Å; P59-Y61 WeakPolarHBondContact O-CD2 3.32Å; P59-Y61 VanDerWaalsContact O-CE2 3.32Å; P59-Y61 WeakPolarHBondContact O-CE2 3.1Å; P59-Y61 PolarHBondContact O-N 3.41Å
60R61.8Low61.9Low242 Ų242122.6 Ų122.691%0.91367%0.665SS**  trans-7280.7177.9-73.1-175.7175.6148.8-1.6107.8T58T58-R60 PolarHBondContact O-N 3.08Å
61Y61.7Low63.2Low132 Ų132119.2 Ų119.252%0.51864%0.642SS.*  trans-62137.2168.6-48.6-74.9000108.1P59 L63P59-Y61 HydrophobicContact CB-CD1 4.45Å; P59-Y61 HydrophobicContact CB-CE1 3.85Å; P59-Y61 HydrophobicContact CB-CE2 3.98Å; P59-Y61 HydrophobicContact CG-CE2 4.38Å; P59-Y61 WeakPolarHBondContact O-CD2 3.32Å; P59-Y61 VanDerWaalsContact O-CE2 3.32Å; P59-Y61 WeakPolarHBondContact O-CE2 3.1Å; P59-Y61 PolarHBondContact O-N 3.41Å; Y61-L63 PolarHBondContact O-N 3.3Å
62P75Confident63.8Low80 Ų80116.5 Ų116.552%0.51963%0.627SS.*  trans-55.5140.2177.823-32.1000109.6L64 Q65P62-L64 PolarHBondContact O-N 3.23Å; P62-Q65 HydrophobicContact CG-CB 4.24Å; P62-Q65 WeakPolarHBondContact O-CB 3.2Å; P62-Q65 PolarHBondContact O-N 2.99Å
63L68.7Low64.8Low135 Ų135109.6 Ų109.671%0.70761%0.614SS**Hα-helixtrans-49.5-34.5-176.7-70.6173.3000112.8Y61 Q65 R66 V67Y61-L63 PolarHBondContact O-N 3.3Å; L63-Q65 VanDerWaalsContact C-N 3.26Å; L63-Q65 PolarHBondContact O-N 3.18Å; L63-R66 PolarHBondContact O-N 3.44Å; L63-R66 VanDerWaalsContact O-N 3.08Å; L63-V67 WeakPolarHBondContact O-CG2 3.48Å; L63-V67 PolarHBondContact O-N 3.46Å
64L65Low65.5Low126 Ų126110.5 Ų110.566%0.6661%0.607SS**Hα-helixtrans-55.5-38.4175.5-64.7-179.8000113P62 S68P62-L64 PolarHBondContact O-N 3.23Å; L64-S68 WeakPolarHBondContact O-CB 3.42Å; L64-S68 PolarHBondContact O-N 2.98Å; L64-S68 PolarHBondContact O-OG 2.97Å
65Q70.5Confident66.2Low125 Ų125108.4 Ų108.458%0.58459%0.593SS**Hα-helixtrans-75.6-25.8-179.8-165.6161.92.500112.5P62 L63P62-Q65 HydrophobicContact CG-CB 4.24Å; P62-Q65 WeakPolarHBondContact O-CB 3.2Å; P62-Q65 PolarHBondContact O-N 2.99Å; L63-Q65 VanDerWaalsContact C-N 3.26Å; L63-Q65 PolarHBondContact O-N 3.18Å
66R72Confident67Low162 Ų162111.2 Ų111.261%0.61159%0.591SS**Hα-helixtrans-75.7-40.8173.8-167-178.2-68.3-163.7-2.1111.7L63 S68L63-R66 PolarHBondContact O-N 3.44Å; L63-R66 VanDerWaalsContact O-N 3.08Å; R66-S68 VanDerWaalsContact C-N 3.32Å
67V72.8Confident67.8Low62 Ų62115.2 Ų115.238%0.37660%0.595SS.*Hα-helixtrans-75.8-23.5179.2-176.60000111.9L63 A69 L70 V71L63-V67 WeakPolarHBondContact O-CG2 3.48Å; L63-V67 PolarHBondContact O-N 3.46Å; V67-A69 PolarHBondContact O-N 2.91Å; V67-A69 VanDerWaalsContact O-N 3.14Å; V67-L70 PolarHBondContact O-N 2.64Å; V67-V71 PolarHBondContact O-N 3.02Å
68S71.6Confident68.3Low32 Ų32112.8 Ų112.822%0.22459%0.589CS.*THydrogen-bonded Turntrans-53.4-32.3175.9-72.30000114.3L64 R66 V71 T75L64-S68 WeakPolarHBondContact O-CB 3.42Å; L64-S68 PolarHBondContact O-N 2.98Å; L64-S68 PolarHBondContact O-OG 2.97Å; R66-S68 VanDerWaalsContact C-N 3.32Å; S68-V71 CarbonylContact O-C 3.59Å; S68-T75 WeakPolarHBondContact OG-CG2 3.36Å
69A69.6Low68.8Low88 Ų88112.7 Ų112.773%0.72759%0.591SS**THydrogen-bonded Turntrans-74.7-30.7176.800000113.2V67V67-A69 PolarHBondContact O-N 2.91Å; V67-A69 VanDerWaalsContact O-N 3.14Å
70L78.6Confident69.2Low145 Ų145119 Ų11976%0.75961%0.605SS**THydrogen-bonded Turntrans-83.6-29.3179.5-65.8170.4000112.1V67V67-L70 PolarHBondContact O-N 2.64Å
71V75.8Confident70Confident53 Ų53113.9 Ų113.932%0.32160%0.596SS.*  trans-131.985.9-179.6-174.80000108.9V67 S68 S73 L74V67-V71 PolarHBondContact O-N 3.02Å; S68-V71 CarbonylContact O-C 3.59Å; V71-S73 WeakPolarHBondContact CG1-OG 3.41Å; V71-S73 PolarHBondContact O-N 3.14Å; V71-S73 VanDerWaalsContact O-N 3.07Å; V71-L74 HydrophobicContact CB-CD1 4.16Å; V71-L74 HydrophobicContact CG1-CB 4.5Å; V71-L74 HydrophobicContact CG1-CD1 3.63Å; V71-L74 PolarHBondContact O-N 2.75Å
72P69.3Low71.4Confident78 Ų78109.1 Ų109.151%0.50658%0.579SS.*Hα-helixtrans-56.8-28.3-179.3-2533.4000112.8L74 T75 W76P72-L74 VanDerWaalsContact C-N 3.25Å; P72-L74 PolarHBondContact O-N 3.21Å; P72-T75 PolarHBondContact O-N 2.85Å; P72-T75 VanDerWaalsContact O-N 3.14Å; P72-T75 PolarHBondContact O-OG1 3.1Å; P72-W76 PolarHBondContact O-N 3.39Å
73S69.7Low72.3Confident85 Ų85108.4 Ų108.459%0.59457%0.573SS**Hα-helixtrans-65.5-20.9178.357.70000114.3V71 T75 W76V71-S73 WeakPolarHBondContact CG1-OG 3.41Å; V71-S73 PolarHBondContact O-N 3.14Å; V71-S73 VanDerWaalsContact O-N 3.07Å; S73-T75 VanDerWaalsContact C-N 3.3Å; S73-W76 PolarHBondContact O-N 2.91Å
74L66.8Low73.5Confident108 Ų108108.7 Ų108.757%0.56557%0.566SS**Hα-helixtrans-71.1-27.9173.6-110.986.8000112.3V71 P72V71-L74 HydrophobicContact CB-CD1 4.16Å; V71-L74 HydrophobicContact CG1-CB 4.5Å; V71-L74 HydrophobicContact CG1-CD1 3.63Å; V71-L74 PolarHBondContact O-N 2.75Å; P72-L74 VanDerWaalsContact C-N 3.25Å; P72-L74 PolarHBondContact O-N 3.21Å
75T67.4Low74.9Confident78 Ų78110.4 Ų110.448%0.47957%0.569SS.*Hα-helixtrans-88.3-10177.163.80000113.6S68 P72 S73 Q77S68-T75 WeakPolarHBondContact OG-CG2 3.36Å; P72-T75 PolarHBondContact O-N 2.85Å; P72-T75 VanDerWaalsContact O-N 3.14Å; P72-T75 PolarHBondContact O-OG1 3.1Å; S73-T75 VanDerWaalsContact C-N 3.3Å; T75-Q77 PolarHBondContact O-N 3.18Å
76W67.7Low76Confident186 Ų186105.1 Ų105.171%0.70555%0.545SS*.  trans-66.398-179.4-101.885.3000109.8P72 S73 P78P72-W76 PolarHBondContact O-N 3.39Å; S73-W76 PolarHBondContact O-N 2.91Å; W76-P78 WeakPolarHBondContact O-CD 3.21Å
77Q69.4Low77Confident166 Ų166106.3 Ų106.378%0.77656%0.563SS**  trans-59.7124.2167.9-75.9-163.5-9.500108.1T75 C79T75-Q77 PolarHBondContact O-N 3.18Å; Q77-C79 PolarHBondContact O-N 3.2Å
78P67.6Low78.1Confident103 Ų103113.3 Ų113.367%0.66959%0.588SS**  trans-61.2112.7176.8-18.428.9000109.3W76 R80W76-P78 WeakPolarHBondContact O-CD 3.21Å; P78-R80 HydrophobicContact CB-CG 4Å; P78-R80 PolarHBondContact O-N 3.33Å
79C66.4Low79.2Confident104 Ų104119.4 Ų119.470%0.70361%0.61SS**  trans-72.541.4171.2-60.90000111.5Q77 N81Q77-C79 PolarHBondContact O-N 3.2Å; C79-N81 PolarHBondContact O-N 3.05Å; C79-N81 PolarHBondContact O-OD1 2.76Å
80R66.6Low80.5Confident209 Ų209117.3 Ų117.379%0.78960%0.598SS**  trans-80.2107.9-179-63.5-165-165.1-164.87.3108.7P78 L82P78-R80 HydrophobicContact CB-CG 4Å; P78-R80 PolarHBondContact O-N 3.33Å; R80-L82 PolarHBondContact O-N 2.97Å
81N77.8Confident81.3Confident134 Ų134117.5 Ų117.572%0.71759%0.593SS**SBendtrans-65.1-18177.2-57.1-18.9000113.1C79 V95C79-N81 PolarHBondContact O-N 3.05Å; C79-N81 PolarHBondContact O-OD1 2.76Å; N81-V95 WeakPolarHBondContact O-CG2 3.49Å
82L90.4Very high82.3Confident32 Ų32119 Ų11917%0.16859%0.593CS.*  trans-136.9133-172.7-169.9136.1000112.4R80 Y84 R92 K148 M149R80-L82 PolarHBondContact O-N 2.97Å; L82-Y84 HydrophobicContact CD2-CD1 4.05Å; L82-Y84 HydrophobicContact CD2-CD2 3.51Å; L82-Y84 HydrophobicContact CD2-CE1 3.85Å; L82-Y84 HydrophobicContact CD2-CE2 3.3Å; L82-Y84 HydrophobicContact CD2-CG 3.86Å; L82-Y84 VanDerWaalsContact CD2-CZ 3.47Å; L82-R92 VanDerWaalsContact CD2-NH2 3.28Å; L82-K148 WeakPolarHBondContact CD1-O 3.41Å; L82-M149 HydrophobicContact CD1-CB 4.4Å; L82-M149 HydrophobicContact CD1-CG 4.14Å
83T93.8Very high83.5Confident65 Ų65120.2 Ų120.240%0.39959%0.59SS.*  trans-110.6110.7177.7-45.10000110.5F85 K93T83-F85 WeakPolarHBondContact CG2-O 3.18Å; T83-K93 HydrophobicContact CG2-CG 4.41Å; T83-K93 PolarHBondContact O-N 2.77Å
84Y94.2Very high84.7Confident141 Ų141118.4 Ų118.455%0.55358%0.577SS**SBendtrans-73.3-43.6179-73-90.5000112.8L82 K91 R92L82-Y84 HydrophobicContact CD2-CD1 4.05Å; L82-Y84 HydrophobicContact CD2-CD2 3.51Å; L82-Y84 HydrophobicContact CD2-CE1 3.85Å; L82-Y84 HydrophobicContact CD2-CE2 3.3Å; L82-Y84 HydrophobicContact CD2-CG 3.86Å; L82-Y84 VanDerWaalsContact CD2-CZ 3.47Å; Y84-K91 CarbonylContact O-C 3.58Å; Y84-R92 WeakPolarHBondContact O-CA 3.41Å; Y84-R92 PolarHBondContact O-N 3.45Å
85F94.5Very high86.1Confident163 Ų163114.6 Ų114.672%0.71556%0.558SS**SBendtrans-128120.1-178.9-58.3-80.1000108.9T83 G90T83-F85 WeakPolarHBondContact CG2-O 3.18Å; F85-G90 WeakPolarHBondContact CD1-O 3.28Å
86S93.6Very high87.4Confident13 Ų13114.6 Ų114.69%0.09156%0.562CS.*  trans-79.1142.6175.869.30000111.3K88 K89 G90 K91S86-K88 VanDerWaalsContact C-N 3.34Å; S86-K88 PolarHBondContact O-N 3.32Å; S86-K89 PolarHBondContact OG-N 3.11Å; S86-G90 WeakPolarHBondContact O-CA 3.09Å; S86-G90 PolarHBondContact O-N 3.02Å; S86-G90 PolarHBondContact OG-N 2.97Å; S86-K91 VanDerWaalsContact CB-O 3.28Å; S86-K91 WeakPolarHBondContact CB-O 3.43Å; S86-K91 PolarHBondContact N-O 2.86Å; S86-K91 PolarHBondContact OG-N 2.99Å; S86-K91 VanDerWaalsContact OG-N 3.15Å; S86-K91 PolarHBondContact OG-O 3.09Å
87L93.4Very high88.7Confident188 Ų188107.6 Ų107.698%0.98454%0.543SS*.THydrogen-bonded Turntrans-58.6-41.3179.2-60.5175.8000113.6
88K95.7Very high90Very high209 Ų209100 Ų10091%0.90951%0.508SS*.THydrogen-bonded Turntrans-78.9-41.4-176.4-64.1-169.7178-170.90114.5S86S86-K88 VanDerWaalsContact C-N 3.34Å; S86-K88 PolarHBondContact O-N 3.32Å
89K95.8Very high91.3Very high159 Ų15996.9 Ų96.969%0.69149%0.487SS*.THydrogen-bonded Turntrans-116.3-4.7-169.8-62.8-169177.9-1720114S86 K91S86-K89 PolarHBondContact OG-N 3.11Å; K89-K91 HydrophobicContact CB-CG 4.5Å; K89-K91 WeakPolarHBondContact O-CG 3.42Å; K89-K91 PolarHBondContact O-N 3.46Å; K89-K91 VanDerWaalsContact O-N 3.08Å
90G96.3Very high92.7Very high45 Ų4598 Ų9846%0.46449%0.487SS..  trans61.113.3-172.600000115.5F85 S86F85-G90 WeakPolarHBondContact CD1-O 3.28Å; S86-G90 WeakPolarHBondContact O-CA 3.09Å; S86-G90 PolarHBondContact O-N 3.02Å; S86-G90 PolarHBondContact OG-N 2.97Å
91K95.9Very high94.2Very high149 Ų14996.9 Ų96.965%0.64848%0.482SS*.  trans-104.3157-174.8-68.2179.7-174.5-173.20112.6Y84 S86 K89Y84-K91 CarbonylContact O-C 3.58Å; S86-K91 VanDerWaalsContact CB-O 3.28Å; S86-K91 WeakPolarHBondContact CB-O 3.43Å; S86-K91 PolarHBondContact N-O 2.86Å; S86-K91 PolarHBondContact OG-N 2.99Å; S86-K91 VanDerWaalsContact OG-N 3.15Å; S86-K91 PolarHBondContact OG-O 3.09Å; K89-K91 HydrophobicContact CB-CG 4.5Å; K89-K91 WeakPolarHBondContact O-CG 3.42Å; K89-K91 PolarHBondContact O-N 3.46Å; K89-K91 VanDerWaalsContact O-N 3.08Å
92R95.4Very high95.1Very high85 Ų8593.1 Ų93.132%0.32146%0.459SS..  trans-60.2140.9172.5-167.9-175.1-166.981-0.7111.5L82 Y84 K148L82-R92 VanDerWaalsContact CD2-NH2 3.28Å; Y84-R92 WeakPolarHBondContact O-CA 3.41Å; Y84-R92 PolarHBondContact O-N 3.45Å; R92-K148 VanDerWaalsContact CZ-O 3.22Å; R92-K148 PolarHBondContact NE-O 3.42Å; R92-K148 PolarHBondContact NH2-O 3.31Å
93K95.3Very high95.4Very high102 Ų10294.6 Ų94.644%0.44347%0.466SS..  trans-105.8137.9172.2-60.2-68-175.9166.60110.8T83T83-K93 HydrophobicContact CG2-CG 4.41Å; T83-K93 PolarHBondContact O-N 2.77Å
94S95.7Very high95.6Very high47 Ų4793.4 Ų93.433%0.32946%0.455SS..  trans-81.2145.1171.153.30000110.6S96 M149S94-S96 PolarHBondContact O-N 3.14Å; S94-M149 WeakPolarHBondContact CA-O 3.27Å
95V95.5Very high95.8Very high28 Ų2886.9 Ų86.917%0.1743%0.429CS..  trans-80.7114174.5-173.70000109.5N81 A97 V98 M149N81-V95 WeakPolarHBondContact O-CG2 3.49Å; V95-A97 VanDerWaalsContact C-N 3.28Å; V95-A97 HydrophobicContact CG1-CB 4.2Å; V95-A97 PolarHBondContact O-N 3.3Å; V95-V98 HydrophobicContact CB-CG2 4.18Å; V95-V98 HydrophobicContact CG1-CG2 4.44Å; V95-V98 WeakPolarHBondContact O-CB 3.47Å; V95-V98 PolarHBondContact O-N 3.03Å; V95-V98 VanDerWaalsContact O-N 3.09Å; V95-M149 HydrophobicContact CB-CE 3.95Å; V95-M149 HydrophobicContact CG1-CE 3.95Å; V95-M149 HydrophobicContact CG2-CB 4.17Å; V95-M149 HydrophobicContact CG2-CE 3.76Å; V95-M149 PolarHBondContact N-O 3.3Å; V95-M149 VanDerWaalsContact N-O 3.11Å
96S94.1Very high95.9Very high79 Ų7983.3 Ų83.355%0.55241%0.414SS*.Hα-helixtrans-60.2-36.1-178.251.40000113S94 V98 T99 D100S94-S96 PolarHBondContact O-N 3.14Å; S96-V98 PolarHBondContact O-N 3.07Å; S96-T99 PolarHBondContact O-N 3.32Å; S96-T99 PolarHBondContact O-OG1 2.96Å; S96-D100 PolarHBondContact O-N 3.06Å
97A95Very high96Very high39 Ų3984.4 Ų84.432%0.32242%0.422SS..Hα-helixtrans-58.4-23177.300000113.8V95 R101V95-A97 VanDerWaalsContact C-N 3.28Å; V95-A97 HydrophobicContact CG1-CB 4.2Å; V95-A97 PolarHBondContact O-N 3.3Å; A97-R101 WeakPolarHBondContact O-CB 3.4Å; A97-R101 WeakPolarHBondContact O-CD 3.44Å; A97-R101 VanDerWaalsContact O-CG 3.26Å; A97-R101 WeakPolarHBondContact O-CG 3.47Å
98V96.5Very high96.1Very high5 Ų576.7 Ų76.73%0.0339%0.388CS..Hα-helixtrans-74.1-47.6173.6172.40000110.6V95 S96 D100 R101 F102 W110 L146 M149 T150V95-V98 HydrophobicContact CB-CG2 4.18Å; V95-V98 HydrophobicContact CG1-CG2 4.44Å; V95-V98 WeakPolarHBondContact O-CB 3.47Å; V95-V98 PolarHBondContact O-N 3.03Å; V95-V98 VanDerWaalsContact O-N 3.09Å; S96-V98 PolarHBondContact O-N 3.07Å; V98-D100 PolarHBondContact O-N 2.89Å; V98-R101 PolarHBondContact O-N 3.2Å; V98-F102 HydrophobicContact CG1-CB 4.49Å; V98-F102 HydrophobicContact CG1-CD2 4.31Å; V98-F102 WeakPolarHBondContact O-CB 3.33Å; V98-F102 PolarHBondContact O-N 3.1Å; V98-W110 HydrophobicContact CG1-CH2 3.96Å; V98-W110 HydrophobicContact CG1-CZ3 3.9Å; V98-L146 HydrophobicContact CB-CD2 4.45Å; V98-L146 HydrophobicContact CG1-CB 4.49Å; V98-L146 HydrophobicContact CG1-CD2 3.74Å; V98-L146 HydrophobicContact CG2-CD2 3.9Å; V98-M149 HydrophobicContact CG2-CB 4.06Å; V98-M149 HydrophobicContact CG2-CE 3.67Å; V98-M149 HydrophobicContact CG2-SD 4.05Å; V98-T150 HydrophobicContact CB-CG2 4.26Å; V98-T150 HydrophobicContact CG1-CG2 3.72Å
99T94.8Very high96.2Very high39 Ų3969 Ų6924%0.23936%0.356CS..Hα-helixtrans-65.3-30.5-177.953.30000112S96 W154S96-T99 PolarHBondContact O-N 3.32Å; S96-T99 PolarHBondContact O-OG1 2.96Å; T99-W154 HydrophobicContact CG2-CD2 3.71Å; T99-W154 HydrophobicContact CG2-CE3 4.11Å; T99-W154 HydrophobicContact CG2-CG 4.27Å; T99-W154 HydrophobicContact CG2-CH2 3.94Å; T99-W154 HydrophobicContact CG2-CZ2 3.53Å; T99-W154 HydrophobicContact CG2-CZ3 4.22Å
100D96.7Very high96.3Very high128 Ų12861.6 Ų61.668%0.68432%0.324SS*.Hα-helixtrans-76.5-25.3179.9-56.6-20.5000112.9S96 V98S96-D100 PolarHBondContact O-N 3.06Å; V98-D100 PolarHBondContact O-N 2.89Å
101R97.3Very high96.4Very high184 Ų18460.1 Ų60.169%0.69431%0.305SS*.Hα-helixtrans-111.4-25.4-169.6-63.8178.8-173.3-174.73.2113.8A97 V98A97-R101 WeakPolarHBondContact O-CB 3.4Å; A97-R101 WeakPolarHBondContact O-CD 3.44Å; A97-R101 VanDerWaalsContact O-CG 3.26Å; A97-R101 WeakPolarHBondContact O-CG 3.47Å; V98-R101 PolarHBondContact O-N 3.2Å
102F98Very high96.5Very high55 Ų5557 Ų5724%0.24129%0.289CS..EExtended strand (participates in β ladder)trans-127.5145.3-174.9-57.6-95.9000110V98 W110 I111 R112 L146V98-F102 HydrophobicContact CG1-CB 4.49Å; V98-F102 HydrophobicContact CG1-CD2 4.31Å; V98-F102 WeakPolarHBondContact O-CB 3.33Å; V98-F102 PolarHBondContact O-N 3.1Å; F102-W110 HydrophobicContact CB-CE3 3.61Å; F102-W110 HydrophobicContact CB-CZ3 3.94Å; F102-I111 WeakPolarHBondContact CA-O 3.04Å; F102-R112 HydrophobicContact CD1-CB 3.72Å; F102-R112 HydrophobicContact CE1-CB 3.87Å; F102-R112 HydrophobicContact CE1-CG 4.44Å; F102-L146 HydrophobicContact CB-CD1 4.49Å; F102-L146 HydrophobicContact CD1-CD1 3.82Å; F102-L146 HydrophobicContact CD2-CD2 4.18Å; F102-L146 HydrophobicContact CE1-CD1 4.13Å; F102-L146 HydrophobicContact CE2-CD2 4.2Å; F102-L146 HydrophobicContact CG-CD1 4.08Å; F102-L146 HydrophobicContact CG-CD2 4.45Å; F102-L146 HydrophobicContact CZ-CD2 4.49Å
103M97.1Very high96.6Very high63 Ų6358.8 Ų58.831%0.3130%0.296SS..EExtended strand (participates in β ladder)trans-114.2135.5175.1-171.6-169.998.100109.4L105 W110 I111 Y165M103-L105 HydrophobicContact CE-CD2 3.51Å; M103-L105 HydrophobicContact CE-CG 4.47Å; M103-W110 WeakPolarHBondContact O-CA 3.09Å; M103-I111 HydrophobicContact CB-CD1 4.07Å; M103-I111 HydrophobicContact CB-CG1 3.66Å; M103-I111 HydrophobicContact CE-CD1 3.16Å; M103-I111 HydrophobicContact CE-CG1 3.96Å; M103-I111 HydrophobicContact CG-CD1 4.45Å; M103-I111 HydrophobicContact CG-CG1 4.45Å; M103-I111 PolarHBondContact N-O 2.94Å; M103-I111 PolarHBondContact O-N 3.46Å; M103-I111 HydrophobicContact SD-CD1 3.84Å; M103-I111 HydrophobicContact SD-CG1 4.45Å; M103-Y165 HydrophobicContact CE-CD1 3.7Å; M103-Y165 HydrophobicContact CE-CD2 3.55Å; M103-Y165 HydrophobicContact CE-CE1 4.16Å; M103-Y165 HydrophobicContact CE-CE2 4.02Å; M103-Y165 HydrophobicContact CE-CG 3.36Å; M103-Y165 HydrophobicContact SD-CD2 3.7Å; M103-Y165 HydrophobicContact SD-CE2 3.78Å; M103-Y165 HydrophobicContact SD-CG 4.17Å
104R97.8Very high96.7Very high41 Ų4156.5 Ų56.516%0.15529%0.286CS..EExtended strand (participates in β ladder)trans-95.4126.5-178.5177.351.5174.2-96.513.1110.5W110 D147R104-W110 HydrophobicContact CB-CD2 4.26Å; R104-W110 HydrophobicContact CB-CE3 3.97Å; R104-W110 HydrophobicContact CB-CH2 3.8Å; R104-W110 HydrophobicContact CB-CZ2 4.08Å; R104-W110 HydrophobicContact CB-CZ3 3.76Å; R104-W110 HydrophobicContact CG-CH2 4.38Å; R104-W110 HydrophobicContact CG-CZ2 4.2Å; R104-D147 IonicContact CZ-OD1 3.33Å; R104-D147 IonicContact CZ-OD2 3.45Å; R104-D147 IonicContact NH1-OD1 2.62Å; R104-D147 PolarHBondContact NH1-OD1 3.03Å; R104-D147 IonicContact NH1-OD2 3.17Å; R104-D147 PolarHBondContact NH1-OD2 3.02Å; R104-D147 VanDerWaalsContact NH1-OD2 3.17Å; R104-D147 IonicContact NH2-OD1 3.46Å; R104-D147 PolarHBondContact NH2-OD1 3.38Å; R104-D147 IonicContact NH2-OD2 2.84Å; R104-D147 PolarHBondContact NH2-OD2 3.44Å
105L97.4Very high96.8Very high4 Ų458.5 Ų58.52%0.02131%0.305CS..  trans-93151.2167.4-58.3176.2000110.4M103 C107 G108 L109 I111 F137M103-L105 HydrophobicContact CE-CD2 3.51Å; M103-L105 HydrophobicContact CE-CG 4.47Å; L105-C107 VanDerWaalsContact C-N 3.3Å; L105-C107 PolarHBondContact O-N 3.23Å; L105-G108 PolarHBondContact O-N 2.74Å; L105-L109 HydrophobicContact CB-CB 4.5Å; L105-L109 HydrophobicContact CD1-CB 4.27Å; L105-L109 PolarHBondContact N-O 3.31Å; L105-I111 HydrophobicContact CD1-CG2 3.98Å; L105-F137 HydrophobicContact CD1-CE1 3.98Å
106H97.2Very high96.9Very high87 Ų8758.7 Ų58.740%0.40331%0.313SS..THydrogen-bonded Turntrans-66-35.2-175.7-176.8-103.8000111.9G108 H169 D170H106-G108 PolarHBondContact O-N 2.81Å; H106-H169 CarbonylContact C-O 3.53Å; H106-H169 HydrophobicContact CB-CB 3.94Å; H106-H169 PolarHBondContact N-ND1 3.11Å; H106-H169 VanDerWaalsContact N-ND1 3.18Å; H106-D170 IonicContact ND1-OD1 3.96Å
107C95Very high97.1Very high37 Ų3757.1 Ų57.125%0.2530%0.295CS..THydrogen-bonded Turntrans-61.64.6173.460.10000115.7L105 Y168 H169 R171L105-C107 VanDerWaalsContact C-N 3.3Å; L105-C107 PolarHBondContact O-N 3.23Å; C107-Y168 PolarHBondContact SG-O 3.49Å; C107-Y168 VanDerWaalsContact SG-O 3.4Å; C107-H169 WeakPolarHBondContact CA-O 3.46Å; C107-H169 WeakPolarHBondContact CB-O 3.47Å; C107-H169 PolarHBondContact N-O 3.04Å; C107-R171 HydrophobicContact CB-CG 3.66Å
108G95.4Very high97.2Very high26 Ų2662.1 Ų62.127%0.26831%0.31SS..SBendtrans89.2-0.8175.600000114.7L105 H106L105-G108 PolarHBondContact O-N 2.74Å; H106-G108 PolarHBondContact O-N 2.81Å
109L97.3Very high97.3Very high47 Ų4769.1 Ų69.125%0.24634%0.34CS..  trans-84.8149.7177-61.6178.8000111.5L105 F137L105-L109 HydrophobicContact CB-CB 4.5Å; L105-L109 HydrophobicContact CD1-CB 4.27Å; L105-L109 PolarHBondContact N-O 3.31Å; L109-F137 HydrophobicContact CB-CD1 4.12Å; L109-F137 HydrophobicContact CB-CE1 4.26Å; L109-F137 HydrophobicContact CD1-CD1 4.09Å; L109-F137 HydrophobicContact CD1-CE1 3.87Å; L109-F137 HydrophobicContact CD1-CZ 4.45Å
110W98.3Very high97.4Very high4 Ų473.7 Ų73.72%0.01536%0.356CS..EExtended strand (participates in β ladder)trans-115.6139.1171.3-71.283.7000109.6V98 F102 M103 R104 F137 C138 L146 D147 T150V98-W110 HydrophobicContact CG1-CH2 3.96Å; V98-W110 HydrophobicContact CG1-CZ3 3.9Å; F102-W110 HydrophobicContact CB-CE3 3.61Å; F102-W110 HydrophobicContact CB-CZ3 3.94Å; M103-W110 WeakPolarHBondContact O-CA 3.09Å; R104-W110 HydrophobicContact CB-CD2 4.26Å; R104-W110 HydrophobicContact CB-CE3 3.97Å; R104-W110 HydrophobicContact CB-CH2 3.8Å; R104-W110 HydrophobicContact CB-CZ2 4.08Å; R104-W110 HydrophobicContact CB-CZ3 3.76Å; R104-W110 HydrophobicContact CG-CH2 4.38Å; R104-W110 HydrophobicContact CG-CZ2 4.2Å; W110-F137 CarbonylContact O-C 3.48Å; W110-F137 WeakPolarHBondContact O-CA 3.11Å; W110-C138 HydrophobicContact CB-CB 3.99Å; W110-C138 PolarHBondContact O-N 3.18Å; W110-L146 HydrophobicContact CB-CD1 3.9Å; W110-L146 HydrophobicContact CD2-CB 3.95Å; W110-L146 HydrophobicContact CD2-CD1 3.75Å; W110-L146 HydrophobicContact CD2-CG 4.5Å; W110-L146 HydrophobicContact CE3-CD1 4.12Å; W110-L146 HydrophobicContact CG-CB 4.32Å; W110-L146 HydrophobicContact CG-CD1 3.68Å; W110-L146 HydrophobicContact CH2-CB 4.41Å; W110-L146 HydrophobicContact CZ2-CB 3.82Å; W110-D147 PolarHBondContact NE1-OD1 3.4Å; W110-T150 HydrophobicContact CH2-CG2 3.77Å; W110-T150 HydrophobicContact CZ2-CG2 4.29Å
111I98Very high97.5Very high13 Ų1370.6 Ų70.67%0.06734%0.339CS..EExtended strand (participates in β ladder)trans-115.2149.8175.465174.8000110.9F102 M103 L105 I135 V136 F137 Y165F102-I111 WeakPolarHBondContact CA-O 3.04Å; M103-I111 HydrophobicContact CB-CD1 4.07Å; M103-I111 HydrophobicContact CB-CG1 3.66Å; M103-I111 HydrophobicContact CE-CD1 3.16Å; M103-I111 HydrophobicContact CE-CG1 3.96Å; M103-I111 HydrophobicContact CG-CD1 4.45Å; M103-I111 HydrophobicContact CG-CG1 4.45Å; M103-I111 PolarHBondContact N-O 2.94Å; M103-I111 PolarHBondContact O-N 3.46Å; M103-I111 HydrophobicContact SD-CD1 3.84Å; M103-I111 HydrophobicContact SD-CG1 4.45Å; L105-I111 HydrophobicContact CD1-CG2 3.98Å; I111-I135 HydrophobicContact CB-CG2 3.77Å; I111-I135 HydrophobicContact CD1-CG2 4.02Å; I111-I135 HydrophobicContact CG1-CG2 4.24Å; I111-I135 HydrophobicContact CG2-CG2 4.45Å; I111-V136 WeakPolarHBondContact CA-O 3.47Å; I111-F137 HydrophobicContact CG2-CD1 3.55Å; I111-F137 HydrophobicContact CG2-CE1 3.51Å; I111-F137 HydrophobicContact CG2-CZ 4.47Å; I111-Y165 HydrophobicContact CD1-CD1 4.16Å; I111-Y165 HydrophobicContact CD1-CE1 3.84Å
112R98.2Very high97.5Very high83 Ų8372.4 Ų72.431%0.31335%0.347SS..EExtended strand (participates in β ladder)trans-145.4160.1179.267.3-179.4-178.889.5-1.5111.9F102 V136F102-R112 HydrophobicContact CD1-CB 3.72Å; F102-R112 HydrophobicContact CE1-CB 3.87Å; F102-R112 HydrophobicContact CE1-CG 4.44Å; R112-V136 PolarHBondContact N-O 2.67Å; R112-V136 PolarHBondContact O-N 2.96Å
113R98.1Very high97.5Very high124 Ų12475.3 Ų75.347%0.46836%0.359SS..EExtended strand (participates in β ladder)trans-84.5148.8166.5-59.9-172.474.5153.611.8110.7Y117R113-Y117 HydrophobicContact CB-CE1 4.47Å; R113-Y117 PolarHBondContact NH1-OH 3.18Å; R113-Y117 VanDerWaalsContact NH1-OH 3.12Å
114K97.9Very high97.6Very high54 Ų5473.4 Ų73.424%0.23535%0.349CS..PPolyproline II helixtrans-69.6138.4172.6-64.5-173.6-168.51560110.4Y117 R131 L132 E134 V136K114-Y117 WeakPolarHBondContact O-CD1 3.19Å; K114-R131 VanDerWaalsContact CD-O 3.27Å; K114-R131 WeakPolarHBondContact CD-O 3.38Å; K114-R131 WeakPolarHBondContact CE-O 3.26Å; K114-R131 PolarHBondContact NZ-O 2.89Å; K114-L132 HydrophobicContact CB-CD2 3.89Å; K114-L132 HydrophobicContact CD-CD2 4.35Å; K114-E134 IonicContact NZ-OE2 3.15Å; K114-E134 PolarHBondContact NZ-OE2 3.23Å; K114-E134 VanDerWaalsContact NZ-OE2 3.15Å; K114-V136 HydrophobicContact CD-CG2 4.22Å; K114-V136 HydrophobicContact CG-CG2 3.97Å
115A97.8Very high97.6Very high88 Ų8877.5 Ų77.573%0.72737%0.373SS*.THydrogen-bonded Turntrans-63.5145.418000000111.4Y117A115-Y117 VanDerWaalsContact C-N 3.27Å; A115-Y117 PolarHBondContact O-N 2.84Å
116G97.6Very high97.7Very high32 Ų3281.6 Ų81.633%0.3340%0.4SS..THydrogen-bonded Turntrans72.712.3176.300000115.1K118 K119 K124G116-K118 PolarHBondContact O-N 2.97Å; G116-K118 VanDerWaalsContact O-N 3.12Å; G116-K119 PolarHBondContact O-N 2.91Å; G116-K124 PolarHBondContact O-NZ 3.39Å
117Y97.8Very high97.7Very high47 Ų4780.2 Ų80.218%0.18440%0.404CS..THydrogen-bonded Turntrans-60.9-18.3177.680.6-80.9000114.6R113 K114 A115 L121 L132R113-Y117 HydrophobicContact CB-CE1 4.47Å; R113-Y117 PolarHBondContact NH1-OH 3.18Å; R113-Y117 VanDerWaalsContact NH1-OH 3.12Å; K114-Y117 WeakPolarHBondContact O-CD1 3.19Å; A115-Y117 VanDerWaalsContact C-N 3.27Å; A115-Y117 PolarHBondContact O-N 2.84Å; Y117-L121 WeakPolarHBondContact O-CD2 3.48Å; Y117-L132 WeakPolarHBondContact CB-O 3.45Å
118K97.9Very high97.9Very high144 Ų14484.6 Ų84.663%0.62642%0.415SS*.THydrogen-bonded Turntrans-106.2-4.5174.4-74.8174170176.60114.5G116G116-K118 PolarHBondContact O-N 2.97Å; G116-K118 VanDerWaalsContact O-N 3.12Å
119K98.1Very high98Very high152 Ų15287.5 Ų87.566%0.66142%0.418SS*.SBendtrans-106139.6-169.4-61.9-63-174.2178.40111.5G116 L121 K124G116-K119 PolarHBondContact O-N 2.91Å; K119-L121 VanDerWaalsContact C-N 3.32Å; K119-L121 PolarHBondContact O-N 2.84Å; K119-K124 VanDerWaalsContact O-CE 3.3Å; K119-K124 WeakPolarHBondContact O-CE 3.47Å; K119-K124 PolarHBondContact O-NZ 3.46Å
120K97.7Very high98Very high135 Ų13592.1 Ų92.159%0.58744%0.436SS*.SBendtrans47.151.7175.2-53.9-174-177.6-176.70112.2K123 K124K120-K123 HydrophobicContact CB-CD 4.37Å; K120-K123 HydrophobicContact CB-CG 4.22Å; K120-K124 WeakPolarHBondContact O-CD 3.45Å; K120-K124 WeakPolarHBondContact O-CG 3.17Å
121L98.1Very high98Very high62 Ų6298.8 Ų98.833%0.32546%0.461SS..  trans-73.4-31.1-174.8-69.8-177.4000113.3Y117 K119 K123 K124 R129Y117-L121 WeakPolarHBondContact O-CD2 3.48Å; K119-L121 VanDerWaalsContact C-N 3.32Å; K119-L121 PolarHBondContact O-N 2.84Å; L121-K123 VanDerWaalsContact C-N 3.28Å; L121-K123 PolarHBondContact O-N 3.17Å; L121-K124 HydrophobicContact CD2-CD 4.14Å; L121-K124 PolarHBondContact O-N 3.35Å; L121-R129 HydrophobicContact CD2-CG 4.18Å
122W97.5Very high98.1Very high223 Ų22399.3 Ų99.385%0.84546%0.464SS*.THydrogen-bonded Turntrans-57.1-38.9-179.159.2-97.9000112.8
123K98.1Very high98Very high116 Ų116102.1 Ų102.150%0.50447%0.474SS..THydrogen-bonded Turntrans-87.12.9177.668.1179.4-171.7173.50115.2K120 L121K120-K123 HydrophobicContact CB-CD 4.37Å; K120-K123 HydrophobicContact CB-CG 4.22Å; L121-K123 VanDerWaalsContact C-N 3.28Å; L121-K123 PolarHBondContact O-N 3.17Å
124K98.4Very high98Very high22 Ų22100.2 Ų100.210%0.09647%0.471CS..SBendtrans-102128.2-176.2-72.8173.8178.91760110.1G116 K119 K120 L121 R129 L132G116-K124 PolarHBondContact O-NZ 3.39Å; K119-K124 VanDerWaalsContact O-CE 3.3Å; K119-K124 WeakPolarHBondContact O-CE 3.47Å; K119-K124 PolarHBondContact O-NZ 3.46Å; K120-K124 WeakPolarHBondContact O-CD 3.45Å; K120-K124 WeakPolarHBondContact O-CG 3.17Å; L121-K124 HydrophobicContact CD2-CD 4.14Å; L121-K124 PolarHBondContact O-N 3.35Å; K124-R129 HydrophobicContact CB-CG 3.75Å; K124-R129 PolarHBondContact O-NE 3.1Å; K124-L132 HydrophobicContact CD-CD1 3.87Å
125L98.3Very high98Very high127 Ų127101.4 Ų101.467%0.66548%0.479SS*.  trans-55.6147.3174.2-77.779000111.7A127 R128 R129L125-A127 VanDerWaalsContact C-N 3.32Å; L125-A127 PolarHBondContact O-N 2.8Å; L125-R128 WeakPolarHBondContact O-CB 3.43Å; L125-R128 PolarHBondContact O-N 2.62Å; L125-R129 PolarHBondContact O-N 3.41Å
126P98.3Very high98Very high90 Ų9099.5 Ų99.558%0.58446%0.458SS*.Hα-helixtrans-50.2-46.3178.4-25.531.8000114R128 R129 K130P126-R128 VanDerWaalsContact C-N 3.33Å; P126-R128 PolarHBondContact O-N 2.74Å; P126-R129 WeakPolarHBondContact O-CB 3.39Å; P126-R129 PolarHBondContact O-N 2.97Å; P126-R129 VanDerWaalsContact O-N 3.09Å; P126-K130 PolarHBondContact O-N 3.05Å
127A98.2Very high98.1Very high58 Ų58103.2 Ų103.248%0.47947%0.466SS..Hα-helixtrans-59.5-41.9177.800000112.5L125 K130 R131L125-A127 VanDerWaalsContact C-N 3.32Å; L125-A127 PolarHBondContact O-N 2.8Å; A127-K130 PolarHBondContact O-N 3.4Å; A127-R131 WeakPolarHBondContact O-CG 3.38Å; A127-R131 PolarHBondContact O-N 3.12Å
128R98.2Very high98.1Very high130 Ų130101.5 Ų101.549%0.49146%0.46SS..Hα-helixtrans-66.1-38.7175.3-173.2178.4-177.3-166.85.9111.5L125 P126 L132L125-R128 WeakPolarHBondContact O-CB 3.43Å; L125-R128 PolarHBondContact O-N 2.62Å; P126-R128 VanDerWaalsContact C-N 3.33Å; P126-R128 PolarHBondContact O-N 2.74Å; R128-L132 HydrophobicContact CG-CD1 4.28Å; R128-L132 WeakPolarHBondContact O-CB 3.5Å; R128-L132 VanDerWaalsContact O-CG 3.3Å; R128-L132 WeakPolarHBondContact O-CG 3.43Å; R128-L132 PolarHBondContact O-N 3.01Å
129R98.3Very high98.1Very high86 Ų8699.6 Ų99.633%0.32546%0.457SS..Hα-helixtrans-62.6-44.3175.8-67.2-173.1-74168.60.7111.1L121 K124 L125 P126 L132 R133L121-R129 HydrophobicContact CD2-CG 4.18Å; K124-R129 HydrophobicContact CB-CG 3.75Å; K124-R129 PolarHBondContact O-NE 3.1Å; L125-R129 PolarHBondContact O-N 3.41Å; P126-R129 WeakPolarHBondContact O-CB 3.39Å; P126-R129 PolarHBondContact O-N 2.97Å; P126-R129 VanDerWaalsContact O-N 3.09Å; R129-L132 PolarHBondContact O-N 2.89Å; R129-R133 WeakPolarHBondContact O-CG 3.4Å; R129-R133 PolarHBondContact O-N 3.34Å
130K98.2Very high98.1Very high144 Ų144101.8 Ų101.863%0.62647%0.466SS*.Hα-helixtrans-57.5-55.3174.5-175.1178178.6-179.90111P126 A127 L132 R133P126-K130 PolarHBondContact O-N 3.05Å; A127-K130 PolarHBondContact O-N 3.4Å; K130-L132 PolarHBondContact O-N 3.31Å; K130-L132 VanDerWaalsContact O-N 3.16Å; K130-R133 PolarHBondContact O-N 3.02Å
131R98.4Very high98.1Very high144 Ų144100.6 Ų100.654%0.54347%0.47SS..Hα-helixtrans-55.6-36.3178.5-71.3-167.4-61-119.25.8113.4K114 A127 E134K114-R131 VanDerWaalsContact CD-O 3.27Å; K114-R131 WeakPolarHBondContact CD-O 3.38Å; K114-R131 WeakPolarHBondContact CE-O 3.26Å; K114-R131 PolarHBondContact NZ-O 2.89Å; A127-R131 WeakPolarHBondContact O-CG 3.38Å; A127-R131 PolarHBondContact O-N 3.12Å; R131-E134 WeakPolarHBondContact CA-OE2 3.41Å
132L98.4Very high98Very high24 Ų24101.2 Ų101.213%0.12647%0.472CS..Hα-helixtrans-72.1-25.8179.8-77.1175.2000113.9K114 Y117 K124 R128 R129 K130 E134K114-L132 HydrophobicContact CB-CD2 3.89Å; K114-L132 HydrophobicContact CD-CD2 4.35Å; Y117-L132 WeakPolarHBondContact CB-O 3.45Å; K124-L132 HydrophobicContact CD-CD1 3.87Å; R128-L132 HydrophobicContact CG-CD1 4.28Å; R128-L132 WeakPolarHBondContact O-CB 3.5Å; R128-L132 VanDerWaalsContact O-CG 3.3Å; R128-L132 WeakPolarHBondContact O-CG 3.43Å; R128-L132 PolarHBondContact O-N 3.01Å; R129-L132 PolarHBondContact O-N 2.89Å; K130-L132 PolarHBondContact O-N 3.31Å; K130-L132 VanDerWaalsContact O-N 3.16Å; L132-E134 VanDerWaalsContact C-N 3.35Å
133R97.9Very high98.1Very high142 Ų14291.2 Ų91.254%0.53644%0.436SS..Hα-helixtrans-78.6-22.7-179.9-68-179.4-147.5141.3-1.3112.8R129 K130R129-R133 WeakPolarHBondContact O-CG 3.4Å; R129-R133 PolarHBondContact O-N 3.34Å; K130-R133 PolarHBondContact O-N 3.02Å
134E97.9Very high98Very high84 Ų8492.6 Ų92.639%0.39344%0.442SS..SBendtrans-58.4142.3177.1-66.3158.6-171.500112K114 R131 L132K114-E134 IonicContact NZ-OE2 3.15Å; K114-E134 PolarHBondContact NZ-OE2 3.23Å; K114-E134 VanDerWaalsContact NZ-OE2 3.15Å; R131-E134 WeakPolarHBondContact CA-OE2 3.41Å; L132-E134 VanDerWaalsContact C-N 3.35Å
135I97.6Very high98Very high80 Ų8096.3 Ų96.341%0.4146%0.462SS..EExtended strand (participates in β ladder)trans-85.4137.5169.9-60.2174.6000107.7I111 Y165I111-I135 HydrophobicContact CB-CG2 3.77Å; I111-I135 HydrophobicContact CD1-CG2 4.02Å; I111-I135 HydrophobicContact CG1-CG2 4.24Å; I111-I135 HydrophobicContact CG2-CG2 4.45Å; I135-Y165 HydrophobicContact CD1-CE1 4.35Å; I135-Y165 WeakPolarHBondContact CD1-OH 3.44Å
136V98.1Very high97.9Very high47 Ų4790.8 Ų90.829%0.28543%0.433SS..EExtended strand (participates in β ladder)trans-129.4149.6-176.3-171.30000110.2I111 R112 K114I111-V136 WeakPolarHBondContact CA-O 3.47Å; R112-V136 PolarHBondContact N-O 2.67Å; R112-V136 PolarHBondContact O-N 2.96Å; K114-V136 HydrophobicContact CD-CG2 4.22Å; K114-V136 HydrophobicContact CG-CG2 3.97Å
137F98.3Very high97.9Very high111 Ų11188.2 Ų88.249%0.48742%0.415SS..EExtended strand (participates in β ladder)trans-69.7157.2170.8-65.3-69.1000113.1L105 L109 W110 I111L105-F137 HydrophobicContact CD1-CE1 3.98Å; L109-F137 HydrophobicContact CB-CD1 4.12Å; L109-F137 HydrophobicContact CB-CE1 4.26Å; L109-F137 HydrophobicContact CD1-CD1 4.09Å; L109-F137 HydrophobicContact CD1-CE1 3.87Å; L109-F137 HydrophobicContact CD1-CZ 4.45Å; W110-F137 CarbonylContact O-C 3.48Å; W110-F137 WeakPolarHBondContact O-CA 3.11Å; I111-F137 HydrophobicContact CG2-CD1 3.55Å; I111-F137 HydrophobicContact CG2-CE1 3.51Å; I111-F137 HydrophobicContact CG2-CZ 4.47Å
138C98.1Very high97.8Very high10 Ų1091.2 Ų91.27%0.06842%0.417CS..PPolyproline II helixtrans-87.6155168.5-72.60000111.6W110 Q142W110-C138 HydrophobicContact CB-CB 3.99Å; W110-C138 PolarHBondContact O-N 3.18Å; C138-Q142 HydrophobicContact CB-CB 4.05Å
139N97.9Very high97.7Very high105 Ų10586.7 Ų86.756%0.56140%0.402SS*.PPolyproline II helixtrans-71.2159.4174.1-64.9-3.4000110.7T141 Q142 C143N139-T141 VanDerWaalsContact C-N 3.3Å; N139-T141 PolarHBondContact O-N 3.18Å; N139-Q142 HydrophobicContact CB-CG 4.31Å; N139-Q142 VanDerWaalsContact N-OE1 3.12Å; N139-Q142 WeakPolarHBondContact O-CB 3.44Å; N139-Q142 PolarHBondContact O-N 3.42Å; N139-C143 PolarHBondContact O-N 3.23Å; N139-C143 PolarHBondContact O-SG 3.44Å; N139-C143 VanDerWaalsContact O-SG 3.36Å
140K97.6Very high97.6Very high197 Ų19782.8 Ų82.886%0.85739%0.387SS*.Hα-helixtrans-52.9-43.4179.7-174175.4-177.6176.50113.4C143 K144K140-C143 PolarHBondContact O-N 2.81Å; K140-K144 PolarHBondContact O-N 3.32Å
141T98.1Very high97.5Very high110 Ų11077.2 Ų77.268%0.67537%0.367SS*.Hα-helixtrans-64.4-41.917852.50000112.1N139 K144 L145N139-T141 VanDerWaalsContact C-N 3.3Å; N139-T141 PolarHBondContact O-N 3.18Å; T141-K144 PolarHBondContact O-N 3.03Å; T141-L145 PolarHBondContact O-N 3.4Å
142Q97.4Very high97.4Very high76 Ų7675.1 Ų75.136%0.35537%0.374SS..Hα-helixtrans-64.9-46.6176.3-65.9175.4-21.600110.8C138 N139 K144 L145 L146C138-Q142 HydrophobicContact CB-CB 4.05Å; N139-Q142 HydrophobicContact CB-CG 4.31Å; N139-Q142 VanDerWaalsContact N-OE1 3.12Å; N139-Q142 WeakPolarHBondContact O-CB 3.44Å; N139-Q142 PolarHBondContact O-N 3.42Å; Q142-K144 VanDerWaalsContact C-N 3.32Å; Q142-K144 PolarHBondContact O-N 3.26Å; Q142-L145 WeakPolarHBondContact O-CB 3.28Å; Q142-L145 PolarHBondContact O-N 2.91Å; Q142-L145 VanDerWaalsContact O-N 3.11Å; Q142-L146 VanDerWaalsContact O-CG 3.28Å; Q142-L146 WeakPolarHBondContact O-CG 3.4Å; Q142-L146 PolarHBondContact O-N 2.9Å
143C97.8Very high97.3Very high13 Ų1380 Ų809%0.08839%0.392CS..Hα-helixtrans-55.7-47.7175.4-64.80000111.1N139 K140 L145 L146 D147N139-C143 PolarHBondContact O-N 3.23Å; N139-C143 PolarHBondContact O-SG 3.44Å; N139-C143 VanDerWaalsContact O-SG 3.36Å; K140-C143 PolarHBondContact O-N 2.81Å; C143-L145 VanDerWaalsContact C-N 3.29Å; C143-L145 PolarHBondContact O-N 2.95Å; C143-L146 PolarHBondContact O-N 3.36Å; C143-D147 WeakPolarHBondContact O-CB 3.44Å; C143-D147 PolarHBondContact O-N 3.32Å
144K97.7Very high97.2Very high144 Ų14478.3 Ų78.363%0.62639%0.385SS*.Hα-helixtrans-60.6-36.8177.6-169.1173.6-175.1175.70112.6K140 T141 Q142 K148K140-K144 PolarHBondContact O-N 3.32Å; T141-K144 PolarHBondContact O-N 3.03Å; Q142-K144 VanDerWaalsContact C-N 3.32Å; Q142-K144 PolarHBondContact O-N 3.26Å; K144-K148 WeakPolarHBondContact O-CG 3.5Å; K144-K148 PolarHBondContact O-N 3.07Å
145L96.8Very high97.1Very high100 Ų10077.9 Ų77.952%0.52438%0.382SS..Hα-helixtrans-67.2-49.1174.817664000111.4T141 Q142 C143 D147 K148 M149T141-L145 PolarHBondContact O-N 3.4Å; Q142-L145 WeakPolarHBondContact O-CB 3.28Å; Q142-L145 PolarHBondContact O-N 2.91Å; Q142-L145 VanDerWaalsContact O-N 3.11Å; C143-L145 VanDerWaalsContact C-N 3.29Å; C143-L145 PolarHBondContact O-N 2.95Å; L145-D147 VanDerWaalsContact C-N 3.25Å; L145-D147 PolarHBondContact O-N 3.11Å; L145-K148 WeakPolarHBondContact O-CA 3.18Å; L145-K148 WeakPolarHBondContact O-CB 3.4Å; L145-K148 PolarHBondContact O-N 3.12Å; L145-M149 HydrophobicContact CD1-CG 4.4Å; L145-M149 HydrophobicContact CD1-SD 4.25Å; L145-M149 HydrophobicContact CG-SD 4.01Å; L145-M149 WeakPolarHBondContact O-CG 3.33Å; L145-M149 PolarHBondContact O-N 2.71Å
146L97.4Very high97Very high11 Ų1180 Ų806%0.05839%0.385CS..Hα-helixtrans-61.6-35.9179.7-63.7172.8000111.6V98 F102 W110 Q142 C143 K148 M149 T150V98-L146 HydrophobicContact CB-CD2 4.45Å; V98-L146 HydrophobicContact CG1-CB 4.49Å; V98-L146 HydrophobicContact CG1-CD2 3.74Å; V98-L146 HydrophobicContact CG2-CD2 3.9Å; F102-L146 HydrophobicContact CB-CD1 4.49Å; F102-L146 HydrophobicContact CD1-CD1 3.82Å; F102-L146 HydrophobicContact CD2-CD2 4.18Å; F102-L146 HydrophobicContact CE1-CD1 4.13Å; F102-L146 HydrophobicContact CE2-CD2 4.2Å; F102-L146 HydrophobicContact CG-CD1 4.08Å; F102-L146 HydrophobicContact CG-CD2 4.45Å; F102-L146 HydrophobicContact CZ-CD2 4.49Å; W110-L146 HydrophobicContact CB-CD1 3.9Å; W110-L146 HydrophobicContact CD2-CB 3.95Å; W110-L146 HydrophobicContact CD2-CD1 3.75Å; W110-L146 HydrophobicContact CD2-CG 4.5Å; W110-L146 HydrophobicContact CE3-CD1 4.12Å; W110-L146 HydrophobicContact CG-CB 4.32Å; W110-L146 HydrophobicContact CG-CD1 3.68Å; W110-L146 HydrophobicContact CH2-CB 4.41Å; W110-L146 HydrophobicContact CZ2-CB 3.82Å; Q142-L146 VanDerWaalsContact O-CG 3.28Å; Q142-L146 WeakPolarHBondContact O-CG 3.4Å; Q142-L146 PolarHBondContact O-N 2.9Å; C143-L146 PolarHBondContact O-N 3.36Å; L146-K148 VanDerWaalsContact C-N 3.29Å; L146-K148 PolarHBondContact O-N 3.22Å; L146-M149 PolarHBondContact O-N 2.89Å; L146-M149 VanDerWaalsContact O-N 3.1Å; L146-T150 PolarHBondContact O-N 3.09Å; L146-T150 PolarHBondContact O-OG1 3.01Å
147D97Very high97Very high37 Ų3780.3 Ų80.320%0.19838%0.381CS..Hα-helixtrans-63-31.8173.2-86.944.6000114R104 W110 C143 L145 K155R104-D147 IonicContact CZ-OD1 3.33Å; R104-D147 IonicContact CZ-OD2 3.45Å; R104-D147 IonicContact NH1-OD1 2.62Å; R104-D147 PolarHBondContact NH1-OD1 3.03Å; R104-D147 IonicContact NH1-OD2 3.17Å; R104-D147 PolarHBondContact NH1-OD2 3.02Å; R104-D147 VanDerWaalsContact NH1-OD2 3.17Å; R104-D147 IonicContact NH2-OD1 3.46Å; R104-D147 PolarHBondContact NH2-OD1 3.38Å; R104-D147 IonicContact NH2-OD2 2.84Å; R104-D147 PolarHBondContact NH2-OD2 3.44Å; W110-D147 PolarHBondContact NE1-OD1 3.4Å; C143-D147 WeakPolarHBondContact O-CB 3.44Å; C143-D147 PolarHBondContact O-N 3.32Å; L145-D147 VanDerWaalsContact C-N 3.25Å; L145-D147 PolarHBondContact O-N 3.11Å; D147-K155 PolarHBondContact O-NZ 3.37Å; D147-K155 IonicContact OD2-NZ 3.35Å; D147-K155 PolarHBondContact OD2-NZ 2.89Å
148K96.1Very high96.8Very high121 Ų12177 Ų7753%0.52637%0.368SS..Hα-helixtrans-77-35.9172.1-69175.7178.2-167.40110.2L82 R92 K144 L145 L146 T150L82-K148 WeakPolarHBondContact CD1-O 3.41Å; R92-K148 VanDerWaalsContact CZ-O 3.22Å; R92-K148 PolarHBondContact NE-O 3.42Å; R92-K148 PolarHBondContact NH2-O 3.31Å; K144-K148 WeakPolarHBondContact O-CG 3.5Å; K144-K148 PolarHBondContact O-N 3.07Å; L145-K148 WeakPolarHBondContact O-CA 3.18Å; L145-K148 WeakPolarHBondContact O-CB 3.4Å; L145-K148 PolarHBondContact O-N 3.12Å; L146-K148 VanDerWaalsContact C-N 3.29Å; L146-K148 PolarHBondContact O-N 3.22Å; K148-T150 VanDerWaalsContact C-N 3.26Å; K148-T150 PolarHBondContact O-N 3.03Å
149M96.6Very high96.8Very high35 Ų3585.7 Ų85.717%0.17240%0.4CS..Hα-helixtrans-73.6-16.5-179.2-66.6178.274.600114.1L82 S94 V95 V98 L145 L146L82-M149 HydrophobicContact CD1-CB 4.4Å; L82-M149 HydrophobicContact CD1-CG 4.14Å; S94-M149 WeakPolarHBondContact CA-O 3.27Å; V95-M149 HydrophobicContact CB-CE 3.95Å; V95-M149 HydrophobicContact CG1-CE 3.95Å; V95-M149 HydrophobicContact CG2-CB 4.17Å; V95-M149 HydrophobicContact CG2-CE 3.76Å; V95-M149 PolarHBondContact N-O 3.3Å; V95-M149 VanDerWaalsContact N-O 3.11Å; V98-M149 HydrophobicContact CG2-CB 4.06Å; V98-M149 HydrophobicContact CG2-CE 3.67Å; V98-M149 HydrophobicContact CG2-SD 4.05Å; L145-M149 HydrophobicContact CD1-CG 4.4Å; L145-M149 HydrophobicContact CD1-SD 4.25Å; L145-M149 HydrophobicContact CG-SD 4.01Å; L145-M149 WeakPolarHBondContact O-CG 3.33Å; L145-M149 PolarHBondContact O-N 2.71Å; L146-M149 PolarHBondContact O-N 2.89Å; L146-M149 VanDerWaalsContact O-N 3.1Å
150T96.7Very high96.7Very high4 Ų486.7 Ų86.73%0.02540%0.4CS..SBendtrans-113.1153.6-178.2530000112.5V98 W110 L146 K148V98-T150 HydrophobicContact CB-CG2 4.26Å; V98-T150 HydrophobicContact CG1-CG2 3.72Å; W110-T150 HydrophobicContact CH2-CG2 3.77Å; W110-T150 HydrophobicContact CZ2-CG2 4.29Å; L146-T150 PolarHBondContact O-N 3.09Å; L146-T150 PolarHBondContact O-OG1 3.01Å; K148-T150 VanDerWaalsContact C-N 3.26Å; K148-T150 PolarHBondContact O-N 3.03Å
151S96Very high96.7Very high27 Ų2784.8 Ų84.819%0.18940%0.398CS..  trans-84.1167.5175.758.40000111.5Y153 W154S151-Y153 PolarHBondContact O-N 3.16Å; S151-W154 PolarHBondContact O-N 2.77Å
152S95.4Very high96.5Very high100 Ų10086.6 Ų86.670%0.69940%0.404SS*.G310 helixtrans-58.3-28.6175.8510000113.4W154 K155 R156S152-W154 PolarHBondContact O-N 3.03Å; S152-K155 WeakPolarHBondContact O-CB 3.41Å; S152-K155 PolarHBondContact O-N 3.22Å; S152-R156 PolarHBondContact O-N 2.92Å
153Y96.1Very high96.5Very high127 Ų12784.8 Ų84.850%0.49840%0.396SS..G310 helixtrans-52.3-38.5175.5175.9-96.6000112.9S151 K155 R156S151-Y153 PolarHBondContact O-N 3.16Å; Y153-K155 VanDerWaalsContact C-N 3.28Å; Y153-K155 PolarHBondContact O-N 3.15Å; Y153-R156 WeakPolarHBondContact O-CD 3.3Å; Y153-R156 WeakPolarHBondContact O-CG 3.44Å; Y153-R156 PolarHBondContact O-NE 3.09Å; Y153-R156 PolarHBondContact OH-NH2 3.4Å
154W96.1Very high96.4Very high105 Ų10588.7 Ų88.740%0.39842%0.421SS..G310 helixtrans-81.6-7179.8-64.4103.3000113.8T99 S151 S152T99-W154 HydrophobicContact CG2-CD2 3.71Å; T99-W154 HydrophobicContact CG2-CE3 4.11Å; T99-W154 HydrophobicContact CG2-CG 4.27Å; T99-W154 HydrophobicContact CG2-CH2 3.94Å; T99-W154 HydrophobicContact CG2-CZ2 3.53Å; T99-W154 HydrophobicContact CG2-CZ3 4.22Å; S151-W154 PolarHBondContact O-N 2.77Å; S152-W154 PolarHBondContact O-N 3.03Å
155K95.8Very high96.3Very high75 Ų7585.1 Ų85.133%0.32640%0.404SS..G310 helixtrans-99-9.2-180-54.5-174.4-173.4-171.90112.4D147 S152 Y153D147-K155 PolarHBondContact O-NZ 3.37Å; D147-K155 IonicContact OD2-NZ 3.35Å; D147-K155 PolarHBondContact OD2-NZ 2.89Å; S152-K155 WeakPolarHBondContact O-CB 3.41Å; S152-K155 PolarHBondContact O-N 3.22Å; Y153-K155 VanDerWaalsContact C-N 3.28Å; Y153-K155 PolarHBondContact O-N 3.15Å
156R96.8Very high96.3Very high126 Ų12682.3 Ų82.348%0.47539%0.389SS..SBendtrans-64.9149.5179.875.9-165.5175.9112.5-5.4111.4S152 Y153S152-R156 PolarHBondContact O-N 2.92Å; Y153-R156 WeakPolarHBondContact O-CD 3.3Å; Y153-R156 WeakPolarHBondContact O-CG 3.44Å; Y153-R156 PolarHBondContact O-NE 3.09Å; Y153-R156 PolarHBondContact OH-NH2 3.4Å
157R96.8Very high96.2Very high52 Ų5289 Ų8920%0.19642%0.417CS..  trans-70.2132.5170.7-172.862174.4-129.33.5109.5W159 H169 D170R157-W159 HydrophobicContact CG-CZ2 4.14Å; R157-H169 VanDerWaalsContact CZ-CB 3.42Å; R157-H169 VanDerWaalsContact NH1-CB 3.35Å; R157-D170 IonicContact CZ-OD1 3.8Å; R157-D170 IonicContact CZ-OD2 3.28Å; R157-D170 VanDerWaalsContact CZ-OD2 3.28Å; R157-D170 IonicContact NH1-OD1 2.74Å; R157-D170 PolarHBondContact NH1-OD1 3.23Å; R157-D170 IonicContact NH1-OD2 2.94Å; R157-D170 PolarHBondContact NH1-OD2 3.22Å; R157-D170 IonicContact NH2-OD2 2.75Å; R157-D170 PolarHBondContact NH2-OD2 3.31Å
158N95.5Very high96.2Very high42 Ų4292.9 Ų92.923%0.22543%0.43CS..  trans-115.1149.3172.3-59.2-49.9000109.1F160N158-F160 HydrophobicContact CB-CD2 3.85Å; N158-F160 HydrophobicContact CB-CE1 4.32Å; N158-F160 HydrophobicContact CB-CE2 3.4Å; N158-F160 VanDerWaalsContact CB-CE2 3.4Å; N158-F160 HydrophobicContact CB-CG 4.49Å; N158-F160 HydrophobicContact CB-CZ 3.67Å
159W96.4Very high96.2Very high193 Ų19387.7 Ų87.773%0.73141%0.408SS*.  trans-126.471.3177.7-65.7102.5000108.5R157R157-W159 HydrophobicContact CG-CZ2 4.14Å
160F96Very high96.2Very high126 Ų12690 Ų9055%0.55342%0.421SS*.  trans-77.6144.6179.3-61.3-59000110.4N158 N162 D163N158-F160 HydrophobicContact CB-CD2 3.85Å; N158-F160 HydrophobicContact CB-CE1 4.32Å; N158-F160 HydrophobicContact CB-CE2 3.4Å; N158-F160 VanDerWaalsContact CB-CE2 3.4Å; N158-F160 HydrophobicContact CB-CG 4.49Å; N158-F160 HydrophobicContact CB-CZ 3.67Å; F160-N162 PolarHBondContact O-N 2.96Å; F160-D163 HydrophobicContact CB-CB 4.07Å
161L97.4Very high96.1Very high157 Ų15796.8 Ų96.882%0.82245%0.446SS*.THydrogen-bonded Turntrans-66.2128.4174.2-173.167.1000109.5D163L161-D163 VanDerWaalsContact C-N 3.3Å; L161-D163 PolarHBondContact O-N 3.34Å
162N95.8Very high96.1Very high148 Ų148101 Ų10179%0.79147%0.47SS*.THydrogen-bonded Turntrans56.534.9176.6-58.1-31000115.2F160 P164F160-N162 PolarHBondContact O-N 2.96Å; N162-P164 WeakPolarHBondContact O-CD 3.46Å
163D95.6Very high95.9Very high38 Ų38104 Ų10420%0.20348%0.478CS..  trans-70.6119.2175.2-175.8-2.2000111.5F160 L161 Y165 Q166F160-D163 HydrophobicContact CB-CB 4.07Å; L161-D163 VanDerWaalsContact C-N 3.3Å; L161-D163 PolarHBondContact O-N 3.34Å; D163-Y165 PolarHBondContact O-N 3.02Å; D163-Y165 VanDerWaalsContact O-N 3.1Å; D163-Y165 WeakPolarHBondContact OD1-CD2 3.3Å; D163-Y165 PolarHBondContact OD1-N 3.24Å; D163-Q166 HydrophobicContact CB-CB 4.37Å; D163-Q166 WeakPolarHBondContact O-CB 3.36Å; D163-Q166 PolarHBondContact O-N 3.32Å
164P96.6Very high95.2Very high94 Ų94106 Ų10661%0.6150%0.497SS*.THydrogen-bonded Turntrans-61.3-19.5176.626.2-36000113.6N162N162-P164 WeakPolarHBondContact O-CD 3.46Å
165Y96.6Very high95.2Very high70 Ų70106.1 Ų106.128%0.27550%0.502SS..THydrogen-bonded Turntrans-94.3-5.1-178.1-60.7-73.7000114.6M103 I111 I135 D163 K167 Y168 H169M103-Y165 HydrophobicContact CE-CD1 3.7Å; M103-Y165 HydrophobicContact CE-CD2 3.55Å; M103-Y165 HydrophobicContact CE-CE1 4.16Å; M103-Y165 HydrophobicContact CE-CE2 4.02Å; M103-Y165 HydrophobicContact CE-CG 3.36Å; M103-Y165 HydrophobicContact SD-CD2 3.7Å; M103-Y165 HydrophobicContact SD-CE2 3.78Å; M103-Y165 HydrophobicContact SD-CG 4.17Å; I111-Y165 HydrophobicContact CD1-CD1 4.16Å; I111-Y165 HydrophobicContact CD1-CE1 3.84Å; I135-Y165 HydrophobicContact CD1-CE1 4.35Å; I135-Y165 WeakPolarHBondContact CD1-OH 3.44Å; D163-Y165 PolarHBondContact O-N 3.02Å; D163-Y165 VanDerWaalsContact O-N 3.1Å; D163-Y165 WeakPolarHBondContact OD1-CD2 3.3Å; D163-Y165 PolarHBondContact OD1-N 3.24Å; Y165-K167 PolarHBondContact O-N 2.74Å; Y165-K167 VanDerWaalsContact O-N 3.1Å; Y165-Y168 HydrophobicContact CD1-CD2 4.23Å; Y165-Y168 PolarHBondContact O-N 3.44Å; Y165-H169 PolarHBondContact O-CD2 3.04Å; Y165-H169 VanDerWaalsContact O-CD2 3.23Å
166Q95.9Very high95.2Very high41 Ų41107.7 Ų107.719%0.19251%0.511CS..G310 helixtrans-50.9-43.7-172.5-170.860.320.400113.1D163 Y168 H169D163-Q166 HydrophobicContact CB-CB 4.37Å; D163-Q166 WeakPolarHBondContact O-CB 3.36Å; D163-Q166 PolarHBondContact O-N 3.32Å; Q166-Y168 PolarHBondContact O-N 3.45Å; Q166-H169 PolarHBondContact O-N 3.27Å
167K95.8Very high95.1Very high152 Ų152106.7 Ų106.766%0.66151%0.513SS*.G310 helixtrans-63.5-19.7179.659.4173.9163.5171.40115.3Y165Y165-K167 PolarHBondContact O-N 2.74Å; Y165-K167 VanDerWaalsContact O-N 3.1Å
168Y96.4Very high95Very high117 Ų117109.9 Ų109.946%0.45953%0.531SS..G310 helixtrans-97.9-2.6-176.3-56.3-66.1000113.2C107 Y165 Q166 D170C107-Y168 PolarHBondContact SG-O 3.49Å; C107-Y168 VanDerWaalsContact SG-O 3.4Å; Y165-Y168 HydrophobicContact CD1-CD2 4.23Å; Y165-Y168 PolarHBondContact O-N 3.44Å; Q166-Y168 PolarHBondContact O-N 3.45Å; Y168-D170 VanDerWaalsContact C-N 3.27Å; Y168-D170 PolarHBondContact O-N 3.33Å
169H96.4Very high94.9Very high13 Ų13114.1 Ų114.16%0.0655%0.551CS.*SBendtrans-70.7-24.6179.5-80.1-89.6000113H106 C107 R157 Y165 Q166H106-H169 CarbonylContact C-O 3.53Å; H106-H169 HydrophobicContact CB-CB 3.94Å; H106-H169 PolarHBondContact N-ND1 3.11Å; H106-H169 VanDerWaalsContact N-ND1 3.18Å; C107-H169 WeakPolarHBondContact CA-O 3.46Å; C107-H169 WeakPolarHBondContact CB-O 3.47Å; C107-H169 PolarHBondContact N-O 3.04Å; R157-H169 VanDerWaalsContact CZ-CB 3.42Å; R157-H169 VanDerWaalsContact NH1-CB 3.35Å; Y165-H169 PolarHBondContact O-CD2 3.04Å; Y165-H169 VanDerWaalsContact O-CD2 3.23Å; Q166-H169 PolarHBondContact O-N 3.27Å
170D96.1Very high94.8Very high84 Ų84108.9 Ų108.945%0.44954%0.539SS..SBendtrans-114.2143.4176.2-57.5-50.4000109.8H106 R157 Y168H106-D170 IonicContact ND1-OD1 3.96Å; R157-D170 IonicContact CZ-OD1 3.8Å; R157-D170 IonicContact CZ-OD2 3.28Å; R157-D170 VanDerWaalsContact CZ-OD2 3.28Å; R157-D170 IonicContact NH1-OD1 2.74Å; R157-D170 PolarHBondContact NH1-OD1 3.23Å; R157-D170 IonicContact NH1-OD2 2.94Å; R157-D170 PolarHBondContact NH1-OD2 3.22Å; R157-D170 IonicContact NH2-OD2 2.75Å; R157-D170 PolarHBondContact NH2-OD2 3.31Å; Y168-D170 VanDerWaalsContact C-N 3.27Å; Y168-D170 PolarHBondContact O-N 3.33Å
171R94.4Very high94.7Very high146 Ų146107.6 Ų107.655%0.55154%0.538SS*.  trans-100.1133.6174.3-63.7171.484.2-155.2-11.4108.3C107 L174C107-R171 HydrophobicContact CB-CG 3.66Å; R171-L174 HydrophobicContact CB-CD1 3.26Å; R171-L174 HydrophobicContact CB-CG 4.24Å; R171-L174 HydrophobicContact CG-CD1 3.94Å; R171-L174 VanDerWaalsContact NE-CD1 3.28Å
172V95.3Very high94.5Very high114 Ų114103.8 Ų103.869%0.69152%0.516SS*.  trans-109.8149.9177.1-63.50000109.1
173N92.3Very high94.4Very high163 Ų163100.2 Ų100.287%0.87249%0.493SS*.  trans57.663.7174-50.9-31.9000114.1
174L81.9Confident94.3Very high170 Ų170105.8 Ų105.889%0.8952%0.519SS*.  trans-127.20179.7-74.5172.8000113.4R171R171-L174 HydrophobicContact CB-CD1 3.26Å; R171-L174 HydrophobicContact CB-CG 4.24Å; R171-L174 HydrophobicContact CG-CD1 3.94Å; R171-L174 VanDerWaalsContact NE-CD1 3.28Å

Retrieved 174 of 174 residues in 247.7 ms (Link to these results)